2,3-dimethyl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]quinoxaline-6-carboxamide

Systemtic Name: 2,3-dimethyl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]quinoxaline-6-carboxamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-2,3-dimethyl-quinoxaline-6-carboxamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2,3-dimethyl-6-quinoxalinecarboxamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2,3-dimethylquinoxaline-6-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-2,3-dimethyl-quinoxaline-6-carboxamide Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)N=C1C

InChI

InChI=1S/C18H16N4O4/c1-10-11(2)21-16-8-12(3-5-15(16)20-10)18(24)19-9-13-7-14(22(25)26)4-6-17(13)23/h3-8,23H,9H2,1-2H3,(H,19,24)